talk-data.com talk-data.com

Topic

generative deep learning

1

tagged

Activity Trend

1 peak/qtr
2020-Q1 2026-Q1

Activities

Showing filtered results

Filtering by: Dr. Yu Xie ×

Talk by Dr. Yu Xie and Dr. Michael Gastegger, Senior Researchers at Microsoft AI4Science. The session covers BioEmu, a generative deep learning system that can generate thousands of statistically independent samples from protein structure ensembles per hour on a single GPU. It discusses training methods, data requirements, and validated results such as relative free energy errors around 1 kcal/mol, and how simultaneous emulation of structural ensembles and thermodynamic properties yields mechanistic insights. Location: H 0110, TU Berlin main building, Straße des 17. Juni 135, 10623 Berlin. Duration approximately 45 minutes.